SCHEMBL4596368

SCHEMBL4596368

Cc1nn(C)cc1C(=O)N1CCCC(c2nc(-c3ccc(F)cc3)no2)C1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.72
GRM5 P41594 1/20 0.71
CLPP Q16740 1/20 0.71
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
TSHR P16473 4/20 0.68
ALDH1A1 P00352 3/20 0.68
LMNA P02545 3/20 0.68
HTT P42858 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
POLB P06746 1/20 0.65
NPSR1 Q6W5P4 2/20 0.62
PKM P14618 1/20 0.62
MAPK1 P28482 2/20 0.61
RAB9A P51151 1/20 0.61
MAPT P10636 1/20 0.61
TP53 P04637 1/20 0.61
ALOX15 P16050 1/20 0.61
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4152495 0.85 GRM5 (0.73) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4136800 0.85 GRM5 (0.73) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4136792 0.85 GRM5 (0.73) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4152490 0.85 GRM5 (0.73) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4151228 0.84 MEN1 (0.82) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4144196 0.84 HSD11B1 (0.85) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4151222 0.84 MEN1 (0.82) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4144201 0.84 HSD11B1 (0.85) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4144889 0.84 GRM5 (0.71) HSD11B1GRM5CLPPMEN1KMT2A
SCHEMBL4144892 0.84 GRM5 (0.71) HSD11B1GRM5CLPPMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1896463-A2 NOVEL OXADIAZOLE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX Pharma S.A. (CH) 2008-03-12 EP disclosed
WO-2006123249-A2 NOVEL OXADIAZOLE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-11-23 WO disclosed